>compound (-)-Epicatechin_(-)-Epicatechin
#instrument UPLC Q-Tof Premier, Waters
>formula C15H14O6
#smiles Oc(c3)c(O)cc(c3)C([H])(O1)C([H])(O)Cc(c(O)2)c(cc(O)c2)1
#RECORD LC-ESI-QTOF_train_data/PR100264.txt;LC-ESI-QTOF_train_data/PR100689.txt
>charge 1
>ionization [M+H]+
>parentmass 291.08683

>collision 5-60
123.0446 658.8
139.0397 905.0
147.0453 204.5
165.0555 129.8
291.0868 127.8

>collision 5-60
81.0353 77.17
83.015 100.0
93.0355 70.39
95.051 101.6
97.0299 175.7
109.0298 620.0
121.0298 149.8
122.0374 108.6
123.0455 558.5
125.0248 362.8
135.0451 71.75
137.0248 221.9
149.0249 118.2
151.0403 232.7
159.0451 97.3
161.0612 121.8
164.0119 81.78
165.0196 97.17
179.0356 148.1
187.041 130.9
188.0487 99.56
203.0721 347.7
205.052 262.8
221.0833 110.0
245.0828 504.9
289.0712 1384.0

